SpectraBase Spectrum ID |
jcxD83Yjv0 |
Name |
9-Hexadecenoic acid, eicosyl ester, (Z)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
534.537581492 u |
Formula |
C36H70O2 |
InChI |
InChI=1S/C36H70O2/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-16-14-12-10-8-6-4-2/h14,16H,3-13,15,17-35H2,1-2H3/b16-14- |
InChIKey |
FIETWBRPSYJUOM-PEZBUJJGSA-N |
Molecular Weight |
534.954 g/mol |
SMILES |
C(OCCCCCCCCCCCCCCCCCCCC)(CCCCCCC\C=C/CCCCCC)=O |